(2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid
TL;DR: (2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid (CAS 182227-17-4) is a chemical compound with molecular formula C15H17NO4S and molecular weight 307.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid
Also Known As: N-betanaphthylsulphonylvaline, b-Naphthalenesulfonyl-D-valine, A-Naphthalenesulfonyl-D-valine, N-(2-Naphthalenylsulfonyl)-D-valine, BAS 01117771
| Molecular Formula | C15H17NO4S |
|---|---|
| Molecular Weight | 307.09 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 91.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 307.08783 |
| Heavy Atoms | 21 |
| Complexity | 469.0 |
Chemical Identifiers
| CAS Number | 182227-17-4 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)O)NS(=O)(=O)C1=CC2=CC=CC=C2C=C1 |
| InChIKey | GFCPZHIUZCLSNZ-AWEZNQCLSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid (CAS 182227-17-4), with molecular formula C15H17NO4S and molecular weight 307.09 g/mol. IUPAC: (2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid.
Chemical Property Profile of (2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid
Property Insights of (2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid
The XLogP value of 3.1 indicates that (2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid. Following Lipinski's Rule of Five, (2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid?
The CAS number of (2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid is 182227-17-4.
What is the molecular formula of (2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid?
The molecular formula of (2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid is C15H17NO4S.
What is the molecular weight of (2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid?
The molecular weight of (2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid is 307.09 g/mol.
Where can I buy (2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid?
You can request a quote for (2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-3-methyl-2-(naphthalen-2-ylsulfonylamino)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.